N-[5-[(E)-(5-bromanylthiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[5-[(E)-(5-bromanylthiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[5-[(E)-(5-bromo-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[5-[(E)-(5-bromo-2-thiophenyl)methylideneamino]-1,3,4-thiadiazol-2-yl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[5-[(E)-(5-bromothiophen-2-yl)methylideneamino]-1,3,4-thiadiazol-2-yl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[5-[(E)-(5-bromo-2-thienyl)methyleneamino]-1,3,4-thiadiazol-2-yl]-4-piperidinosulfonyl-benzamide Formula: C19H18BrN5O3S3 MolecularWeight: 540.47692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(S3)N=CC4=CC=C(S4)Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(S3)/N=C/C4=CC=C(S4)Br

InChI

InChI=1S/C19H18BrN5O3S3/c20-16-9-6-14(29-16)12-21-18-23-24-19(30-18)22-17(26)13-4-7-15(8-5-13)31(27,28)25-10-2-1-3-11-25/h4-9,12H,1-3,10-11H2,(H,22,24,26)/b21-12+